UniProt Q8E9N3
3-isopropylmalate dehydrogenase (Q8E9N3)
3-isopropylmalate dehydrogenase (UniProt Q8E9N3), EC 1.1.1.85: 24 experimental structures and 1 predicted model on GenesisL1, 4 ligands bound, 73 pockets. Binding sites, druggability and experiment against prediction (TM-score)…
- UniProt
- Q8E9N3
- Protein
- 3-isopropylmalate dehydrogenase
- EC
- 1.1.1.85
- Experimental structures
- 24
- Predicted models
- 1
- Ligands
- 4
- Pockets
- 73 · 25 records with a druggable one
Structures
25 records of Q8E9N3 in the MolNFT archive: 24 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 3VKZ | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at atmospheric pressure | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.57) |
| 3VKZ | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at atmospheric pressure | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.57) |
| 3VL2 | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 160 MPa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.56) |
| 3VL2 | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 160 mpa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.56) |
| 3VL3 | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 340 MPa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VL3 | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 340 mpa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VL4 | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 410 MPa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.56) |
| 3VL4 | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 410 mpa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.56) |
| 3VL6 | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 580 MPa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VL6 | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 580 mpa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VL7 | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 650 MPa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VL7 | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 650 mpa | x-ray diffraction | A | IPM, CA, CL | 3 (best 0.55) |
| 3VMJ | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 | x-ray diffraction | A | IPM, MG, CL | 3 (best 0.57) |
| 3VMJ | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 | x-ray diffraction | A | IPM, MG, CL | 3 (best 0.57) |
| 3VML | Chimera 3-isopropylmalate dehydrogenase between Shewanella oneidensis MR-1 (O) and Shewanella… | x-ray diffraction | A | IPM, MG, CL | 2 (best 0.58) |
| 3VML | Chimera 3-isopropylmalate dehydrogenase between shewanella oneidensis mr-1 (O) and shewanella… | x-ray diffraction | A | IPM, MG, CL | 2 (best 0.58) |
| 3WZV | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 0.1MPa - complex with IPM and Mg | x-ray diffraction | A | IPM, MG | 3 (best 0.57) |
| 3WZV | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 0.1MPA - complex with ipm and mg | x-ray diffraction | A | IPM, MG | 3 (best 0.57) |
| 3WZW | 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 580MPa - complex with IPM and Mg | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| 3WZW | 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 580MPA - complex with ipm and mg | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| 3WZX | S266A mutant 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 0.1MPa - complex… | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| 3WZX | S266A mutant 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 0.1MPA - complex… | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| 3WZY | S266A mutant 3-isopropylmalate dehydrogenase from Shewanella oneidensis MR-1 at 580MPa - complex… | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| 3WZY | S266A mutant 3-isopropylmalate dehydrogenase from shewanella oneidensis mr-1 at 580MPA - complex… | x-ray diffraction | A | IPM, MG | 3 (best 0.56) |
| Q8E9N3 | AlphaFold monomer V2.0 prediction for 3-isopropylmalate dehydrogenase (Q8E9N3) | predicted | A | — | 3 (best 0.56) |
Ligands
Experiment against prediction
- 3VMJ chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.36 Å
- 3VMJ chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.36 Å
- 3VML chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.40 Å
- 3VML chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.40 Å
- 3WZX chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.46 Å
- 3WZX chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.46 Å
- 3WZV chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.48 Å
- 3WZV chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.48 Å
- 3WZY chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.48 Å
- 3WZY chain A against the predicted model Q8E9N3: TM-score 1.00, RMSD 0.48 Å
Elsewhere
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